4-Chloro-9H-dipyrido[2,3-b;4',3'-d]pyrrole-6-carboxylic acid

HCID 58365083
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Basic information

Standard SMILES
O=C(O)c1cc2c(cn1)[nH]c1nccc(Cl)c12
InChIKey
ZSWBLEPFBRGQDG-UHFFFAOYSA-N
Molecular formula
C11H6ClN3O2
Average molar mass
247.64 g/mol

Names & identifiers

Preferred name
4-Chloro-9H-dipyrido[2,3-b;4',3'-d]pyrrole-6-carboxylic acid
IUPAC
13-chloro-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene-4-carboxylic acid

Names & synonyms

SCHEMBL2014349ZSWBLEPFBRGQDG-UHFFFAOYSA-N4-Chloro-9H-dipyrido[2,3-b;4',3'-d]pyrrole-6-carboxylic acid

Database identifiers

PubChem CID
58365083

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
78.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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